Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 9/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | PGR | P06401 | 2/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.49 |
| ▸ | AADAC | P22760 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4100002 | 0.85 | ALDH5A1 (0.53) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL16951259 | 0.83 | SIRT6 (0.50) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL213627 | 0.77 | SIRT6 (0.54) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL16958996 | 0.77 | TDP1 (0.58) | CYP3A4LMNACYP1A2CYP2C9TSHR | |
| SCHEMBL29351198 | 0.77 | SIRT6 (0.54) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL16952667 | 0.76 | APP (0.43) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL1998640 | 0.75 | CYP3A4 (0.52) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL16958859 | 0.75 | TSHR (0.60) | CYP3A4LMNACYP1A2CYP2C9TSHR | |
| SCHEMBL377777 | 0.75 | ATM (0.60) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL2639009 | 0.75 | SIRT6 (0.51) | ARCYP3A4LMNACYP1A2CYP2C9 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |